Summary

IMPPAT Phytochemical identifier: IMPHY014990

Phytochemical name: Linoleic acid

Synonymous chemical names:
(e,e)-9,12-octadecadienoic acid (syn. linoleic acid), (z,z)-9,12-octadecadienoic acid (linoleic acid), (z,z,z)-9,12,15-octadecatrienoic acid (linoleic acid), linoleic, linoleic acid, linoleic acids, linolic acid

External chemical identifiers:
CID:5280450, ChEMBL:CHEMBL267476, ChEBI:17351, ZINC:ZINC000004474613, FDASRS:9KJL21T0QJ, SureChEMBL:SCHEMBL7067, MolPort-001-788-459

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Chemical structure information

SMILES:
CCCCC/C=CC/C=CCCCCCCCC(=O)O

InChI:
InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-

InChIKey:
OYHQOLUKZRVURQ-HZJYTTRNSA-N

DeepSMILES:
CCCCC/C=CC/C=CCCCCCCCC=O)O

Functional groups:
C/C=CC, CC(=O)O

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Lineolic acids and derivatives

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty Acids and Conjugates

NP Classifier Class: Unsaturated fatty acids

NP-Likeness score: 1.187

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Chemical structure download